Chemical Properties of 1,3-Dioxane, 4-methyl-2-phenyl- (CAS 774-44-7)

1,3-Dioxane, 4-methyl-2-phenyl-

InChI
InChI=1S/C11H14O2/c1-9-7-8-12-11(13-9)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3
InChI Key
NJDSRMVYAFOBIZ-UHFFFAOYSA-N
Formula
C11H14O2
SMILES
CC1CCOC(c2ccccc2)O1
Molecular Weight1
178.23
CAS
774-44-7
Other Names
  • 2-Phenyl-4-methyl-1,3-dioxane
  • 4-Methyl-2-phenyl-1,3-dioxane
  • 4-Methyl-2-phenyl-m-dioxane
  • m-Dioxane, 4-methyl-2-phenyl-
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Physical Properties

Property Value Unit Source
ΔfH°gas -274.66 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 27.15 kJ/mol Joback Calculated Property
ΔvapH° 64.92 kJ/mol Relay (1.0) Calculated Property
IE 8.92 eV Relay (1.0) Calculated Property
logPoct/wat 2.511 Crippen Calculated Property
McVol 142.970 ml/mol McGowan Calculated Property
Tboil 490.61 K Relay (1.0) Calculated Property
Tfus 305.38 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [350.66; 447.10] J/mol×K [546.74; 786.75] Show Hide
Cp,gas 350.66 J/mol×K 546.74 Joback Calculated Property
Cp,gas 369.88 J/mol×K 586.74 Joback Calculated Property
Cp,gas 387.79 J/mol×K 626.74 Joback Calculated Property
Cp,gas 404.43 J/mol×K 666.74 Joback Calculated Property
Cp,gas 419.83 J/mol×K 706.75 Joback Calculated Property
Cp,gas 434.04 J/mol×K 746.75 Joback Calculated Property
Cp,gas 447.10 J/mol×K 786.75 Joback Calculated Property
η [0.0002724; 0.0038201] Pa×s [296.43; 546.74] Show Hide
η 0.0038201 Pa×s 296.43 Joback Calculated Property
η 0.0018750 Pa×s 338.15 Joback Calculated Property
η 0.0010760 Pa×s 379.87 Joback Calculated Property
η 0.0006892 Pa×s 421.59 Joback Calculated Property
η 0.0004784 Pa×s 463.30 Joback Calculated Property
η 0.0003526 Pa×s 505.02 Joback Calculated Property
η 0.0002724 Pa×s 546.74 Joback Calculated Property

Similar Compounds

1,3-Dioxane, 2-phenyl-. 1,3-Dioxolane, 4-methyl-2-phenyl-. tolyaldehyde propylene glycol acetal. 4-(4,5-Dimethyl-1,3-dioxolan-2-yl)-2-methoxyphenol. 1,3-Dioxolane, 2-(4-methoxyphenyl)-4-methyl, # 1. 1,3-Dioxolane, 2-(4-methoxyphenyl)-4-methyl-. 2-methoxy-4-(4-methyl-1,3-dioxolan-2-yl)phenol. [1,1,1-2H3]-4-Benzyloxy-2-butanol. 3-(Hexadecyloxy)-2-benzofuran-1(3h)-one. Benzyl «beta»-D-glucopyranoside, TFA. Benzyl alcohol, rutinoside, TFA. benzyl 6- O-(«alpha»-L-arabinofuranosyl)-«beta»-D-glucopyranoside, TFA. Benzenemethanol, Gly, TFA. (2R,3R)-(-)-2-Benzyloxy-1,3,4-butanetriol, tris(trifluoroacetate). Etaconazole.

Find more compounds similar to 1,3-Dioxane, 4-methyl-2-phenyl-.

Sources

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